trans-1,2-Dibromocyclohexane
Completing data — refresh the page later to see the latest
Basic information
- CAS
7429-37-0- Standard SMILES
Br[C@@H]1CCCC[C@H]1Br- InChIKey
CZNHKZKWKJNOTE-PHDIDXHHSA-N- Molecular formula
- C6H10Br2
- Average molar mass
- 241.95 g/mol
- Monoisotopic mass
- 239.91493
Names & identifiers
- Preferred name
- trans-1,2-Dibromocyclohexane
- IUPAC
- trans-(1R,2R)-1,2-dibromocyclohexane
- English name
- TRANS-1,2-DIBROMOCYCLOHEXANE
- Molecular formula
- C6H10Br2
- Molecular weight
- 241.95
Names & synonyms
trans-1,2-Dibromocyclohexane7429-37-0EINECS 231-070-2DTXSID70225304NSC 92176RefChem:898696DTXCID30147795231-070-2(1r,2r)-1,2-dibromocyclohexaneMFCD00003820trans-1.2-DibromocyclohexaneCyclohexane,2-dibromo-, trans-
Show more names
Dibromocyclohexanetrans-1,2-Dibromocyclohexanrel-1β*,2α*-Dibromocyclohexanetrans-1,2-Dibromocyclohexane,99%(+/-)-trans-1，2-Dibromocyclohexanerel-(1R*,2R*)-1,2-Dibromocyclohexane)-trans-1,2-Dibromocyclohexane(+/-)-trans-1,2-Dibromocyclohexane>trans-1,2-DibroMocyclohexane, 99% 25ML
NSC92176NSC-921761217522-88-7trans-1,2-DibromcyclohexanSCHEMBL5376743trans-1,2-Dibromocyclohexane, 99%AKOS017342827rac-(1R,2R)-1,2-dibromocyclohexane
Database identifiers
- CAS
7429-37-0- PubChem CID
- 98506
- DTXSID
DTXSID70225304- EC Number
- 231-070-2
- Nikkaji
- J37.463F
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 62.9
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Halogenated Cyclic Hydrocarbons
Physical DescriptionClear slightly yellow liquid; [Acros Organics MSDS]
Physicochemical properties
- Melting point
- -5 °C · -5 °C
- Boiling point
- 145 °C · 145 °C (100 mmHg)
- Density
- 1.78 · 1.78
- refractive index
- 1.551 · 1.551-1.553
- Flash point
- 113 °C · 113 °C
- storage temp.
- Sealed in dry,Room Temperature
- form
- Liquid
- Specific Gravity
- 1.79 · 1.79
- color
- Clear slightly yellow
- Stability
- Stable. Incompatible with strong oxidizing agents, strong bases.
- InChI
- 1S/C6H10Br2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4H2/t5-,6-/m1/s1
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazards SummaryMay cause irritation; [Acros Organics MSDS]
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29035980
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
Usestrans-1,2-Dibromocyclohexane is used as pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
2 records
Compound notes
Loading…